2-({5,7-dimethyl-6-[(3-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(furan-2-yl)methyl]acetamide
Chemical Structure Depiction of
2-({5,7-dimethyl-6-[(3-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(furan-2-yl)methyl]acetamide
2-({5,7-dimethyl-6-[(3-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(furan-2-yl)methyl]acetamide
Compound characteristics
| Compound ID: | C121-0127 |
| Compound Name: | 2-({5,7-dimethyl-6-[(3-methylphenyl)methyl][1,2,4]triazolo[1,5-a]pyrimidin-2-yl}sulfanyl)-N-[(furan-2-yl)methyl]acetamide |
| Molecular Weight: | 421.52 |
| Molecular Formula: | C22 H23 N5 O2 S |
| Smiles: | Cc1cccc(Cc2c(C)nc3nc(nn3c2C)SCC(NCc2ccco2)=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.1712 |
| logD: | 4.1711 |
| logSw: | -4.3586 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.775 |
| InChI Key: | HGBSVBWNNQQKHI-UHFFFAOYSA-N |